J40
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O12 | P1 | doub | 1.48Å | 1.46Å | |
| O3 | C3 | sing | 1.43Å | 1.40Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C2 | O2 | sing | 1.43Å | 1.40Å | |
| C1 | O1 | sing | 1.43Å | 1.40Å | |
| C1 | C6 | sing | 1.53Å | 1.53Å | |
| O1 | P1 | sing | 1.61Å | 1.65Å | |
| P1 | O13 | sing | 1.61Å | 1.65Å | |
| P1 | O11 | sing | 1.61Å | 1.46Å | |
| C7 | O13 | sing | 1.43Å | 1.40Å | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| O4 | C4 | sing | 1.43Å | 1.40Å | |
| O4 | P4 | sing | 1.61Å | 1.65Å | |
| C4 | C5 | sing | 1.53Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C5 | O5 | sing | 1.43Å | 1.40Å | |
| C26 | C25 | sing | 1.51Å | 1.53Å | |
| C6 | O6 | sing | 1.43Å | 1.40Å | |
| C25 | C24 | doub | 1.31Å | 1.53Å | |
| O17 | C10 | doub | 1.21Å | 1.18Å | |
| O42 | P4 | doub | 1.48Å | 1.46Å | |
| P4 | O41 | sing | 1.61Å | 1.46Å | |
| P4 | O43 | sing | 1.61Å | 1.46Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C8 | O16 | sing | 1.45Å | 1.40Å | |
| C9 | O18 | sing | 1.45Å | 1.40Å | |
| C10 | O16 | sing | 1.34Å | 1.40Å | |
| C10 | C12 | sing | 1.51Å | 1.53Å | |
| C23 | C24 | sing | 1.51Å | 1.53Å | |
| C23 | C22 | sing | 1.51Å | 1.53Å | |
| C17 | C16 | sing | 1.51Å | 1.53Å | |
| C17 | C18 | sing | 1.51Å | 1.53Å | |
| C22 | C21 | doub | 1.31Å | 1.53Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| O18 | C11 | sing | 1.34Å | 1.40Å | |
| C16 | C15 | doub | 1.31Å | 1.53Å | |
| C19 | C18 | doub | 1.31Å | 1.53Å | |
| C19 | C20 | sing | 1.51Å | 1.53Å | |
| C15 | C14 | sing | 1.51Å | 1.53Å | |
| C21 | C20 | sing | 1.51Å | 1.53Å | |
| C11 | O19 | doub | 1.21Å | 1.19Å | |
| C11 | C31 | sing | 1.51Å | 1.53Å | |
| C31 | C32 | sing | 1.53Å | 1.53Å | |
| C32 | C33 | sing | 1.53Å | 1.53Å | |
| C33 | C34 | sing | 1.53Å | 1.53Å | |
| C34 | C35 | sing | 1.53Å | 1.53Å | |
| C35 | C36 | sing | 1.53Å | 1.53Å | |
| C36 | C37 | sing | 1.53Å | 1.53Å | |
| C37 | C38 | sing | 1.53Å | 1.53Å | |
| C38 | C39 | sing | 1.53Å | 1.53Å | |
| C39 | C40 | sing | 1.53Å | 1.53Å | |
| C40 | C41 | sing | 1.53Å | 1.53Å | |
| C42 | C41 | sing | 1.53Å | 1.53Å | |
| C42 | C43 | sing | 1.53Å | 1.53Å | |
| O11 | H1 | sing | 0.97Å | 0.95Å | |
| O6 | H2 | sing | 0.97Å | 0.95Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| O2 | H6 | sing | 0.97Å | 0.95Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| O3 | H8 | sing | 0.97Å | 0.95Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| O41 | H10 | sing | 0.97Å | 0.95Å | |
| O43 | H11 | sing | 0.97Å | 0.95Å | |
| C5 | H12 | sing | 1.09Å | 1.10Å | |
| O5 | H13 | sing | 0.97Å | 0.95Å | |
| C7 | H14 | sing | 1.09Å | 1.10Å | |
| C7 | H15 | sing | 1.09Å | 1.10Å | |
| C8 | H16 | sing | 1.09Å | 1.10Å | |
| C9 | H17 | sing | 1.09Å | 1.10Å | |
| C9 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.09Å | 1.10Å | |
| C13 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C14 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.08Å | 1.08Å | |
| C16 | H27 | sing | 1.08Å | 1.08Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| C17 | H30 | sing | 1.09Å | 1.10Å | |
| C18 | H31 | sing | 1.08Å | 1.08Å | |
| C19 | H33 | sing | 1.08Å | 1.08Å | |
| C20 | H35 | sing | 1.09Å | 1.10Å | |
| C20 | H36 | sing | 1.09Å | 1.10Å | |
| C21 | H37 | sing | 1.08Å | 1.08Å | |
| C22 | H39 | sing | 1.08Å | 1.08Å | |
| C23 | H41 | sing | 1.09Å | 1.10Å | |
| C23 | H42 | sing | 1.09Å | 1.10Å | |
| C24 | H43 | sing | 1.08Å | 1.08Å | |
| C31 | H45 | sing | 1.09Å | 1.10Å | |
| C31 | H46 | sing | 1.09Å | 1.10Å | |
| C32 | H47 | sing | 1.09Å | 1.10Å | |
| C32 | H48 | sing | 1.09Å | 1.10Å | |
| C33 | H49 | sing | 1.09Å | 1.10Å | |
| C33 | H50 | sing | 1.09Å | 1.10Å | |
| C34 | H51 | sing | 1.09Å | 1.10Å | |
| C34 | H52 | sing | 1.09Å | 1.10Å | |
| C35 | H53 | sing | 1.09Å | 1.10Å | |
| C35 | H54 | sing | 1.09Å | 1.10Å | |
| C36 | H55 | sing | 1.09Å | 1.10Å | |
| C36 | H56 | sing | 1.09Å | 1.10Å | |
| C37 | H57 | sing | 1.09Å | 1.10Å | |
| C37 | H58 | sing | 1.09Å | 1.10Å | |
| C38 | H59 | sing | 1.09Å | 1.10Å | |
| C38 | H60 | sing | 1.09Å | 1.10Å | |
| C39 | H61 | sing | 1.09Å | 1.10Å | |
| C39 | H62 | sing | 1.09Å | 1.10Å | |
| C40 | H63 | sing | 1.09Å | 1.10Å | |
| C40 | H64 | sing | 1.09Å | 1.10Å | |
| C25 | H65 | sing | 1.08Å | 1.08Å | |
| C26 | H67 | sing | 1.09Å | 1.10Å | |
| C26 | H68 | sing | 1.09Å | 1.10Å | |
| C26 | H69 | sing | 1.09Å | 1.10Å | |
| C41 | H70 | sing | 1.09Å | 1.10Å | |
| C41 | H71 | sing | 1.09Å | 1.10Å | |
| C42 | H72 | sing | 1.09Å | 1.10Å | |
| C42 | H73 | sing | 1.09Å | 1.10Å | |
| C43 | H74 | sing | 1.09Å | 1.10Å | |
| C43 | H75 | sing | 1.09Å | 1.10Å | |
| C43 | H76 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O12 | P1 | O1 | 111.4° | 109.5° |
| O12 | P1 | O13 | 111.6° | 109.4° |
| O12 | P1 | O11 | 101.3° | 109.5° |
| O3 | C3 | C2 | 109.6° | 109.5° |
| O3 | C3 | C4 | 109.7° | 109.5° |
| O3 | C3 | H7 | 110.7° | 109.5° |
| C3 | O3 | H8 | 109.5° | 114.0° |
| C2 | C3 | C4 | 108.9° | 109.5° |
| C3 | C2 | C1 | 111.0° | 109.5° |
| C3 | C2 | O2 | 109.1° | 109.5° |
| C3 | C2 | H5 | 108.6° | 109.4° |
| C2 | C3 | H7 | 109.0° | 109.5° |
| C3 | C4 | O4 | 109.9° | 109.5° |
| C3 | C4 | C5 | 108.1° | 109.5° |
| C4 | C3 | H7 | 109.0° | 109.4° |
| C3 | C4 | H9 | 109.1° | 109.5° |
| C1 | C2 | O2 | 109.1° | 109.5° |
| C2 | C1 | O1 | 107.2° | 109.4° |
| C2 | C1 | C6 | 112.0° | 109.5° |
| C2 | C1 | H3 | 108.9° | 109.5° |
| C1 | C2 | H5 | 108.6° | 109.5° |
| O2 | C2 | H5 | 110.4° | 109.5° |
| C2 | O2 | H6 | 109.5° | 113.9° |
| O1 | C1 | C6 | 109.1° | 109.5° |
| C1 | O1 | P1 | 119.9° | 123.0° |
| O1 | C1 | H3 | 110.7° | 109.5° |
| C1 | C6 | C5 | 111.8° | 109.5° |
| C1 | C6 | O6 | 109.1° | 109.4° |
| C6 | C1 | H3 | 108.9° | 109.5° |
| C1 | C6 | H4 | 108.6° | 109.5° |
| O1 | P1 | O13 | 109.8° | 109.5° |
| O1 | P1 | O11 | 111.0° | 109.5° |
| O13 | P1 | O11 | 111.4° | 109.5° |
| P1 | O13 | C7 | 119.0° | 123.0° |
| P1 | O11 | H1 | 109.5° | 114.0° |
| O13 | C7 | C8 | 109.3° | 109.5° |
| O13 | C7 | H14 | 109.5° | 109.5° |
| O13 | C7 | H15 | 109.5° | 109.5° |
| C7 | C8 | C9 | 109.0° | 109.5° |
| C7 | C8 | O16 | 109.8° | 109.5° |
| C8 | C7 | H14 | 109.5° | 109.4° |
| C8 | C7 | H15 | 109.5° | 109.5° |
| C7 | C8 | H16 | 108.8° | 109.5° |
| C4 | O4 | P4 | 118.7° | 123.1° |
| O4 | C4 | C5 | 109.9° | 109.5° |
| O4 | C4 | H9 | 110.8° | 109.4° |
| O4 | P4 | O42 | 114.2° | 109.4° |
| O4 | P4 | O41 | 114.1° | 109.5° |
| O4 | P4 | O43 | 114.3° | 109.5° |
| C4 | C5 | C6 | 109.8° | 109.5° |
| C4 | C5 | O5 | 109.3° | 109.5° |
| C5 | C4 | H9 | 109.1° | 109.4° |
| C4 | C5 | H12 | 108.9° | 109.5° |
| C6 | C5 | O5 | 109.3° | 109.5° |
| C5 | C6 | O6 | 108.2° | 109.4° |
| C5 | C6 | H4 | 108.7° | 109.5° |
| C6 | C5 | H12 | 108.9° | 109.5° |
| O5 | C5 | H12 | 110.7° | 109.4° |
| C5 | O5 | H13 | 109.5° | 114.0° |
| C26 | C25 | C24 | 113.1° | 120.0° |
| C26 | C25 | H65 | 123.4° | 120.0° |
| C25 | C26 | H67 | 109.5° | 109.4° |
| C25 | C26 | H68 | 109.5° | 109.5° |
| C25 | C26 | H69 | 109.4° | 109.4° |
| C6 | O6 | H2 | 109.5° | 114.0° |
| O6 | C6 | H4 | 110.5° | 109.5° |
| C25 | C24 | C23 | 113.0° | 120.0° |
| C25 | C24 | H43 | 123.5° | 120.0° |
| C24 | C25 | H65 | 123.5° | 120.0° |
| O17 | C10 | O16 | 120.3° | 120.1° |
| O17 | C10 | C12 | 119.1° | 120.0° |
| O42 | P4 | O41 | 104.4° | 109.5° |
| O42 | P4 | O43 | 104.3° | 109.5° |
| O41 | P4 | O43 | 104.2° | 109.5° |
| P4 | O41 | H10 | 109.5° | 114.0° |
| P4 | O43 | H11 | 109.5° | 113.9° |
| C9 | C8 | O16 | 109.7° | 109.4° |
| C8 | C9 | O18 | 110.3° | 109.5° |
| C9 | C8 | H16 | 108.9° | 109.5° |
| C8 | C9 | H17 | 109.3° | 109.5° |
| C8 | C9 | H18 | 109.3° | 109.5° |
| C8 | O16 | C10 | 114.8° | 117.0° |
| O16 | C8 | H16 | 110.6° | 109.5° |
| C9 | O18 | C11 | 114.7° | 117.0° |
| O18 | C9 | H17 | 109.2° | 109.5° |
| O18 | C9 | H18 | 109.2° | 109.4° |
| O16 | C10 | C12 | 120.5° | 120.0° |
| C10 | C12 | C13 | 108.7° | 109.5° |
| C10 | C12 | H19 | 109.7° | 109.5° |
| C10 | C12 | H20 | 109.6° | 109.5° |
| C24 | C23 | C22 | 109.6° | 109.4° |
| C24 | C23 | H41 | 109.4° | 109.5° |
| C24 | C23 | H42 | 109.4° | 109.5° |
| C23 | C24 | H43 | 123.5° | 120.0° |
| C23 | C22 | C21 | 113.7° | 120.0° |
| C23 | C22 | H39 | 123.2° | 120.0° |
| C22 | C23 | H41 | 109.5° | 109.5° |
| C22 | C23 | H42 | 109.4° | 109.5° |
| C16 | C17 | C18 | 109.6° | 109.5° |
| C17 | C16 | C15 | 113.2° | 120.0° |
| C17 | C16 | H27 | 123.4° | 120.0° |
| C16 | C17 | H29 | 109.5° | 109.4° |
| C16 | C17 | H30 | 109.4° | 109.5° |
| C17 | C18 | C19 | 112.7° | 120.0° |
| C18 | C17 | H29 | 109.4° | 109.5° |
| C18 | C17 | H30 | 109.4° | 109.5° |
| C17 | C18 | H31 | 123.6° | 120.0° |
| C22 | C21 | C20 | 114.2° | 120.0° |
| C22 | C21 | H37 | 122.9° | 120.0° |
| C21 | C22 | H39 | 123.2° | 120.0° |
| C12 | C13 | C14 | 110.0° | 109.5° |
| C13 | C12 | H19 | 109.6° | 109.4° |
| C13 | C12 | H20 | 109.7° | 109.5° |
| C12 | C13 | H21 | 109.3° | 109.5° |
| C12 | C13 | H22 | 109.4° | 109.5° |
| C13 | C14 | C15 | 109.6° | 109.5° |
| C14 | C13 | H21 | 109.3° | 109.5° |
| C14 | C13 | H22 | 109.3° | 109.4° |
| C13 | C14 | H23 | 109.5° | 109.5° |
| C13 | C14 | H24 | 109.5° | 109.4° |
| O18 | C11 | O19 | 120.4° | 120.0° |
| O18 | C11 | C31 | 119.7° | 120.0° |
| C16 | C15 | C14 | 113.0° | 120.0° |
| C16 | C15 | H25 | 123.5° | 120.0° |
| C15 | C16 | H27 | 123.4° | 120.0° |
| C18 | C19 | C20 | 112.5° | 120.0° |
| C19 | C18 | H31 | 123.7° | 120.0° |
| C18 | C19 | H33 | 123.7° | 120.0° |
| C19 | C20 | C21 | 110.3° | 109.5° |
| C20 | C19 | H33 | 123.7° | 120.0° |
| C19 | C20 | H35 | 109.2° | 109.5° |
| C19 | C20 | H36 | 109.2° | 109.5° |
| C15 | C14 | H23 | 109.4° | 109.5° |
| C15 | C14 | H24 | 109.4° | 109.4° |
| C14 | C15 | H25 | 123.5° | 120.0° |
| C21 | C20 | H35 | 109.3° | 109.4° |
| C21 | C20 | H36 | 109.3° | 109.5° |
| C20 | C21 | H37 | 122.9° | 120.0° |
| O19 | C11 | C31 | 119.9° | 120.0° |
| C11 | C31 | C32 | 109.4° | 109.5° |
| C11 | C31 | H45 | 109.5° | 109.4° |
| C11 | C31 | H46 | 109.5° | 109.5° |
| C31 | C32 | C33 | 109.7° | 109.5° |
| C32 | C31 | H45 | 109.5° | 109.5° |
| C32 | C31 | H46 | 109.5° | 109.5° |
| C31 | C32 | H47 | 109.4° | 109.5° |
| C31 | C32 | H48 | 109.4° | 109.5° |
| C32 | C33 | C34 | 109.3° | 109.4° |
| C33 | C32 | H47 | 109.4° | 109.5° |
| C33 | C32 | H48 | 109.4° | 109.5° |
| C32 | C33 | H49 | 109.5° | 109.5° |
| C32 | C33 | H50 | 109.5° | 109.5° |
| C33 | C34 | C35 | 109.9° | 109.5° |
| C34 | C33 | H49 | 109.5° | 109.4° |
| C34 | C33 | H50 | 109.5° | 109.5° |
| C33 | C34 | H51 | 109.3° | 109.4° |
| C33 | C34 | H52 | 109.3° | 109.5° |
| C34 | C35 | C36 | 109.7° | 109.5° |
| C35 | C34 | H51 | 109.4° | 109.5° |
| C35 | C34 | H52 | 109.3° | 109.5° |
| C34 | C35 | H53 | 109.4° | 109.5° |
| C34 | C35 | H54 | 109.4° | 109.5° |
| C35 | C36 | C37 | 109.7° | 109.5° |
| C36 | C35 | H53 | 109.4° | 109.5° |
| C36 | C35 | H54 | 109.4° | 109.4° |
| C35 | C36 | H55 | 109.4° | 109.4° |
| C35 | C36 | H56 | 109.4° | 109.4° |
| C36 | C37 | C38 | 109.9° | 109.5° |
| C37 | C36 | H55 | 109.4° | 109.5° |
| C37 | C36 | H56 | 109.4° | 109.5° |
| C36 | C37 | H57 | 109.4° | 109.5° |
| C36 | C37 | H58 | 109.3° | 109.5° |
| C37 | C38 | C39 | 109.4° | 109.5° |
| C38 | C37 | H57 | 109.4° | 109.5° |
| C38 | C37 | H58 | 109.4° | 109.5° |
| C37 | C38 | H59 | 109.5° | 109.5° |
| C37 | C38 | H60 | 109.5° | 109.5° |
| C38 | C39 | C40 | 109.7° | 109.5° |
| C39 | C38 | H59 | 109.5° | 109.5° |
| C39 | C38 | H60 | 109.5° | 109.5° |
| C38 | C39 | H61 | 109.4° | 109.5° |
| C38 | C39 | H62 | 109.4° | 109.5° |
| C39 | C40 | C41 | 109.9° | 109.5° |
| C40 | C39 | H61 | 109.4° | 109.5° |
| C40 | C39 | H62 | 109.4° | 109.5° |
| C39 | C40 | H63 | 109.4° | 109.5° |
| C39 | C40 | H64 | 109.4° | 109.4° |
| C40 | C41 | C42 | 109.9° | 109.4° |
| C41 | C40 | H63 | 109.3° | 109.5° |
| C41 | C40 | H64 | 109.4° | 109.5° |
| C40 | C41 | H70 | 109.4° | 109.4° |
| C40 | C41 | H71 | 109.4° | 109.5° |
| C41 | C42 | C43 | 109.3° | 109.4° |
| C42 | C41 | H70 | 109.3° | 109.5° |
| C42 | C41 | H71 | 109.4° | 109.5° |
| C41 | C42 | H72 | 109.5° | 109.5° |
| C41 | C42 | H73 | 109.5° | 109.5° |
| C43 | C42 | H72 | 109.5° | 109.4° |
| C43 | C42 | H73 | 109.5° | 109.5° |
| C42 | C43 | H74 | 109.5° | 109.5° |
| C42 | C43 | H75 | 109.4° | 109.5° |
| C42 | C43 | H76 | 109.5° | 109.5° |
| H14 | C7 | H15 | 109.5° | 109.5° |
| H17 | C9 | H18 | 109.5° | 109.5° |
| H19 | C12 | H20 | 109.5° | 109.5° |
| H21 | C13 | H22 | 109.5° | 109.4° |
| H23 | C14 | H24 | 109.5° | 109.5° |
| H29 | C17 | H30 | 109.5° | 109.5° |
| H35 | C20 | H36 | 109.5° | 109.4° |
| H41 | C23 | H42 | 109.4° | 109.5° |
| H45 | C31 | H46 | 109.5° | 109.5° |
| H47 | C32 | H48 | 109.5° | 109.4° |
| H49 | C33 | H50 | 109.5° | 109.5° |
| H51 | C34 | H52 | 109.5° | 109.5° |
| H53 | C35 | H54 | 109.5° | 109.5° |
| H55 | C36 | H56 | 109.5° | 109.5° |
| H57 | C37 | H58 | 109.5° | 109.4° |
| H59 | C38 | H60 | 109.4° | 109.4° |
| H61 | C39 | H62 | 109.5° | 109.5° |
| H63 | C40 | H64 | 109.5° | 109.5° |
| H67 | C26 | H68 | 109.5° | 109.5° |
| H67 | C26 | H69 | 109.5° | 109.5° |
| H68 | C26 | H69 | 109.5° | 109.5° |
| H70 | C41 | H71 | 109.5° | 109.5° |
| H72 | C42 | H73 | 109.4° | 109.5° |
| H74 | C43 | H75 | 109.5° | 109.4° |
| H74 | C43 | H76 | 109.5° | 109.5° |
| H75 | C43 | H76 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O12 | P1 | O1 | C1 | 51.8° | 55.0° |
| O12 | P1 | O1 | O13 | 124.2° | 120.0° |
| O12 | P1 | O1 | O11 | 112.1° | 120.0° |
| O12 | P1 | O13 | O11 | 112.5° | 120.0° |
| O12 | P1 | O13 | C7 | 38.6° | 55.0° |
| O12 | P1 | O11 | H1 | 0.0° | 180.0° |
| O3 | C3 | C2 | C4 | 119.9° | 120.0° |
| O3 | C3 | C2 | H7 | 121.3° | 120.0° |
| O3 | C3 | C4 | H7 | 121.4° | 120.0° |
| O3 | C3 | C2 | C1 | 179.3° | 180.0° |
| O3 | C3 | C2 | O2 | 59.0° | 60.0° |
| O3 | C3 | C4 | O4 | 55.5° | 60.0° |
| O3 | C3 | C4 | C5 | 175.4° | 180.0° |
| O3 | C3 | C2 | H5 | 61.4° | 60.0° |
| O3 | C3 | C4 | H9 | 66.2° | 60.0° |
| C2 | C3 | C4 | H7 | 118.7° | 120.0° |
| C3 | C2 | C1 | O2 | 120.3° | 120.0° |
| C3 | C2 | C1 | H5 | 119.4° | 120.0° |
| C3 | C2 | O2 | H5 | 119.3° | 120.0° |
| C3 | C2 | C1 | O1 | 171.5° | 180.0° |
| C3 | C2 | C1 | C6 | 51.9° | 60.0° |
| C2 | C3 | C4 | O4 | 175.3° | 180.0° |
| C2 | C3 | C4 | C5 | 64.8° | 59.9° |
| C3 | C2 | C1 | H3 | 68.6° | 60.0° |
| C3 | C2 | O2 | H6 | 180.0° | 60.0° |
| C2 | C3 | O3 | H8 | 180.0° | 60.0° |
| C2 | C3 | C4 | H9 | 53.7° | 60.0° |
| C4 | C3 | C2 | C1 | 59.3° | 60.0° |
| C4 | C3 | C2 | O2 | 60.9° | 60.0° |
| C3 | C4 | O4 | C5 | 118.8° | 120.1° |
| C3 | C4 | O4 | H9 | 120.6° | 120.0° |
| C3 | C4 | O4 | P4 | 137.3° | 119.9° |
| C3 | C4 | C5 | H9 | 118.5° | 120.0° |
| C3 | C4 | C5 | C6 | 63.0° | 60.0° |
| C3 | C4 | C5 | O5 | 177.1° | 180.0° |
| C4 | C3 | C2 | H5 | 178.7° | 180.0° |
| C4 | C3 | O3 | H8 | 60.5° | 180.0° |
| C3 | C4 | C5 | H12 | 56.1° | 60.1° |
| C1 | C2 | O2 | H5 | 119.2° | 120.0° |
| C2 | C1 | O1 | C6 | 121.5° | 120.0° |
| C2 | C1 | O1 | H3 | 118.7° | 120.0° |
| C2 | C1 | C6 | H3 | 120.5° | 120.0° |
| C2 | C1 | O1 | P1 | 167.5° | 120.0° |
| C2 | C1 | C6 | C5 | 50.1° | 60.0° |
| C2 | C1 | C6 | O6 | 169.7° | 180.0° |
| C2 | C1 | C6 | H4 | 69.8° | 60.0° |
| C1 | C2 | O2 | H6 | 58.5° | 180.0° |
| C1 | C2 | C3 | H7 | 59.4° | 60.0° |
| O2 | C2 | C1 | O1 | 51.2° | 60.0° |
| O2 | C2 | C1 | C6 | 68.4° | 60.0° |
| O2 | C2 | C1 | H3 | 171.0° | 180.0° |
| O2 | C2 | C3 | H7 | 179.7° | 179.9° |
| O1 | C1 | C6 | H3 | 121.0° | 120.0° |
| C1 | O1 | P1 | O13 | 176.0° | 175.0° |
| C1 | O1 | P1 | O11 | 60.4° | 65.0° |
| O1 | C1 | C6 | C5 | 168.6° | 180.0° |
| O1 | C1 | C6 | O6 | 71.8° | 60.1° |
| O1 | C1 | C6 | H4 | 48.7° | 60.0° |
| O1 | C1 | C2 | H5 | 69.1° | 60.0° |
| C6 | C1 | O1 | P1 | 71.0° | 120.0° |
| C1 | C6 | C5 | C4 | 55.8° | 60.0° |
| C1 | C6 | C5 | O6 | 120.2° | 119.9° |
| C1 | C6 | C5 | H4 | 119.9° | 120.0° |
| C1 | C6 | C5 | O5 | 175.6° | 180.0° |
| C1 | C6 | O6 | H4 | 119.3° | 120.0° |
| C1 | C6 | O6 | H2 | 180.0° | 179.9° |
| C6 | C1 | C2 | H5 | 171.3° | 180.0° |
| C1 | C6 | C5 | H12 | 63.4° | 60.0° |
| O1 | P1 | O13 | O11 | 123.4° | 120.0° |
| O1 | P1 | O13 | C7 | 162.7° | 175.0° |
| O1 | P1 | O11 | H1 | 118.5° | 60.0° |
| P1 | O1 | C1 | H3 | 48.8° | 0.1° |
| P1 | O13 | C7 | C8 | 113.8° | 180.0° |
| O13 | P1 | O11 | H1 | 118.8° | 60.0° |
| P1 | O13 | C7 | H14 | 6.2° | 60.0° |
| P1 | O13 | C7 | H15 | 126.3° | 60.0° |
| O11 | P1 | O13 | C7 | 73.9° | 65.0° |
| O13 | C7 | C8 | H14 | 120.0° | 120.0° |
| O13 | C7 | C8 | H15 | 120.0° | 120.1° |
| O13 | C7 | C8 | C9 | 73.0° | 55.0° |
| O13 | C7 | C8 | O16 | 47.2° | 65.0° |
| O13 | C7 | H14 | H15 | 120.0° | 120.0° |
| O13 | C7 | C8 | H16 | 168.4° | 175.0° |
| C7 | C8 | C9 | O16 | 120.3° | 120.0° |
| C7 | C8 | C9 | H16 | 118.5° | 120.0° |
| C7 | C8 | O16 | H16 | 120.1° | 120.0° |
| C7 | C8 | C9 | O18 | 112.2° | 55.0° |
| C7 | C8 | O16 | C10 | 79.7° | 90.0° |
| C8 | C7 | H14 | H15 | 120.1° | 120.0° |
| C7 | C8 | C9 | H17 | 127.7° | 175.0° |
| C7 | C8 | C9 | H18 | 7.9° | 65.0° |
| O4 | C4 | C5 | H9 | 121.6° | 119.9° |
| O4 | C4 | C5 | C6 | 177.1° | 179.9° |
| O4 | C4 | C5 | O5 | 57.2° | 59.9° |
| C4 | O4 | P4 | O42 | 109.1° | 55.1° |
| C4 | O4 | P4 | O41 | 130.8° | 175.0° |
| C4 | O4 | P4 | O43 | 11.0° | 64.9° |
| O4 | C4 | C3 | H7 | 65.9° | 60.0° |
| O4 | C4 | C5 | H12 | 63.8° | 60.0° |
| P4 | O4 | C4 | C5 | 103.9° | 120.0° |
| O4 | P4 | O42 | O41 | 125.3° | 120.0° |
| O4 | P4 | O42 | O43 | 125.5° | 120.0° |
| O4 | P4 | O41 | O43 | 125.4° | 120.1° |
| P4 | O4 | C4 | H9 | 16.7° | 0.1° |
| O4 | P4 | O41 | H10 | 125.4° | 180.0° |
| O4 | P4 | O43 | H11 | 125.5° | 60.1° |
| C4 | C5 | C6 | O5 | 119.9° | 120.0° |
| C4 | C5 | C6 | H12 | 119.1° | 120.0° |
| C4 | C5 | O5 | H12 | 119.9° | 119.9° |
| C4 | C5 | C6 | O6 | 175.9° | 180.0° |
| C4 | C5 | C6 | H4 | 64.1° | 60.0° |
| C5 | C4 | C3 | H7 | 54.0° | 60.1° |
| C4 | C5 | O5 | H13 | 180.0° | 180.0° |
| C6 | C5 | O5 | H12 | 119.9° | 120.0° |
| C5 | C6 | O6 | H4 | 118.9° | 120.0° |
| C5 | C6 | O6 | H2 | 58.2° | 60.1° |
| C5 | C6 | C1 | H3 | 70.5° | 60.0° |
| C6 | C5 | C4 | H9 | 55.4° | 60.0° |
| C6 | C5 | O5 | H13 | 59.8° | 60.0° |
| O5 | C5 | C6 | O6 | 64.2° | 60.0° |
| O5 | C5 | C6 | H4 | 55.8° | 60.0° |
| O5 | C5 | C4 | H9 | 64.4° | 60.0° |
| C26 | C25 | C24 | H65 | 180.0° | 180.0° |
| C26 | C25 | C24 | C23 | 61.5° | 0.1° |
| C26 | C25 | C24 | H43 | 118.5° | 180.0° |
| C25 | C26 | H67 | H68 | 120.0° | 120.0° |
| C25 | C26 | H67 | H69 | 120.0° | 119.9° |
| C25 | C26 | H68 | H69 | 120.0° | 120.0° |
| O6 | C6 | C1 | H3 | 49.2° | 60.0° |
| O6 | C6 | C5 | H12 | 56.8° | 59.9° |
| C25 | C24 | C23 | H43 | 180.0° | 179.9° |
| C25 | C24 | C23 | C22 | 102.2° | 125.0° |
| C25 | C24 | C23 | H41 | 137.8° | 5.0° |
| C25 | C24 | C23 | H42 | 17.9° | 115.0° |
| C24 | C25 | C26 | H67 | 180.0° | 180.0° |
| C24 | C25 | C26 | H68 | 60.0° | 60.0° |
| C24 | C25 | C26 | H69 | 60.0° | 60.1° |
| O17 | C10 | O16 | C8 | 47.7° | 0.0° |
| O17 | C10 | O16 | C12 | 179.7° | 180.0° |
| O17 | C10 | C12 | C13 | 29.3° | 0.0° |
| O17 | C10 | C12 | H19 | 90.6° | 120.0° |
| O17 | C10 | C12 | H20 | 149.2° | 120.0° |
| O42 | P4 | O41 | O43 | 109.2° | 120.0° |
| O42 | P4 | O41 | H10 | 0.0° | 60.1° |
| O42 | P4 | O43 | H11 | 0.0° | 180.0° |
| O41 | P4 | O43 | H11 | 109.2° | 60.0° |
| O43 | P4 | O41 | H10 | 109.2° | 59.9° |
| C9 | C8 | O16 | H16 | 120.1° | 120.0° |
| C8 | C9 | O18 | H17 | 120.1° | 120.1° |
| C8 | C9 | O18 | H18 | 120.2° | 120.0° |
| C9 | C8 | O16 | C10 | 160.5° | 150.0° |
| C8 | C9 | O18 | C11 | 107.0° | 180.0° |
| C9 | C8 | C7 | H14 | 167.0° | 175.0° |
| C9 | C8 | C7 | H15 | 46.9° | 65.1° |
| C8 | C9 | H17 | H18 | 119.7° | 120.0° |
| O16 | C8 | C9 | O18 | 8.1° | 65.0° |
| C8 | O16 | C10 | C12 | 132.6° | 180.0° |
| O16 | C8 | C7 | H14 | 72.8° | 55.0° |
| O16 | C8 | C7 | H15 | 167.2° | 175.0° |
| O16 | C8 | C9 | H17 | 112.0° | 55.0° |
| O16 | C8 | C9 | H18 | 128.2° | 175.0° |
| C9 | O18 | C11 | O19 | 39.6° | 0.0° |
| C9 | O18 | C11 | C31 | 140.2° | 180.0° |
| O18 | C9 | C8 | H16 | 129.3° | 175.0° |
| O18 | C9 | H17 | H18 | 119.6° | 119.9° |
| O16 | C10 | C12 | C13 | 150.5° | 180.0° |
| C10 | O16 | C8 | H16 | 40.4° | 30.0° |
| O16 | C10 | C12 | H19 | 89.6° | 60.0° |
| O16 | C10 | C12 | H20 | 30.6° | 60.0° |
| C10 | C12 | C13 | H19 | 119.9° | 120.0° |
| C10 | C12 | C13 | H20 | 119.9° | 120.0° |
| C10 | C12 | C13 | C14 | 178.2° | 179.9° |
| C10 | C12 | H19 | H20 | 120.3° | 120.0° |
| C10 | C12 | C13 | H21 | 58.1° | 60.0° |
| C10 | C12 | C13 | H22 | 61.7° | 60.0° |
| C24 | C23 | C22 | H41 | 120.0° | 120.0° |
| C24 | C23 | C22 | H42 | 120.0° | 120.0° |
| C24 | C23 | C22 | C21 | 92.6° | 126.4° |
| C24 | C23 | C22 | H39 | 87.4° | 53.7° |
| C24 | C23 | H41 | H42 | 119.9° | 120.0° |
| C23 | C24 | C25 | H65 | 118.5° | 180.0° |
| C23 | C22 | C21 | H39 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 64.7° | 7.5° |
| C23 | C22 | C21 | H37 | 115.3° | 172.5° |
| C22 | C23 | H41 | H42 | 120.0° | 120.0° |
| C22 | C23 | C24 | H43 | 77.8° | 55.0° |
| C16 | C17 | C18 | H29 | 120.1° | 120.0° |
| C16 | C17 | C18 | H30 | 120.0° | 120.0° |
| C17 | C16 | C15 | H27 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 171.9° | 125.0° |
| C17 | C16 | C15 | C14 | 177.6° | 179.9° |
| C17 | C16 | C15 | H25 | 2.4° | 0.0° |
| C16 | C17 | H29 | H30 | 119.9° | 120.0° |
| C16 | C17 | C18 | H31 | 8.1° | 55.0° |
| C18 | C17 | C16 | C15 | 84.0° | 125.0° |
| C17 | C18 | C19 | H31 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 158.2° | 180.0° |
| C18 | C17 | C16 | H27 | 95.9° | 55.0° |
| C18 | C17 | H29 | H30 | 119.9° | 120.0° |
| C17 | C18 | C19 | H33 | 21.8° | 0.0° |
| C22 | C21 | C20 | C19 | 37.8° | 127.6° |
| C22 | C21 | C20 | H37 | 180.0° | 180.0° |
| C22 | C21 | C20 | H35 | 82.3° | 7.6° |
| C22 | C21 | C20 | H36 | 157.9° | 112.3° |
| C21 | C22 | C23 | H41 | 27.4° | 113.6° |
| C21 | C22 | C23 | H42 | 147.4° | 6.4° |
| C12 | C13 | C14 | H21 | 120.1° | 120.0° |
| C12 | C13 | C14 | H22 | 120.1° | 120.0° |
| C12 | C13 | C14 | C15 | 135.8° | 180.0° |
| C13 | C12 | H19 | H20 | 120.4° | 120.0° |
| C12 | C13 | H21 | H22 | 119.8° | 120.0° |
| C12 | C13 | C14 | H23 | 15.9° | 60.0° |
| C12 | C13 | C14 | H24 | 104.1° | 60.0° |
| C13 | C14 | C15 | C16 | 78.2° | 125.0° |
| C13 | C14 | C15 | H23 | 120.0° | 120.1° |
| C13 | C14 | C15 | H24 | 120.0° | 119.9° |
| C14 | C13 | C12 | H19 | 61.9° | 60.0° |
| C14 | C13 | C12 | H20 | 58.3° | 60.0° |
| C14 | C13 | H21 | H22 | 119.7° | 119.9° |
| C13 | C14 | H23 | H24 | 120.0° | 120.0° |
| C13 | C14 | C15 | H25 | 101.8° | 54.9° |
| O18 | C11 | O19 | C31 | 179.9° | 180.0° |
| O18 | C11 | C31 | C32 | 89.7° | 180.0° |
| C11 | O18 | C9 | H17 | 13.1° | 59.9° |
| C11 | O18 | C9 | H18 | 132.8° | 60.0° |
| O18 | C11 | C31 | H45 | 150.4° | 60.0° |
| O18 | C11 | C31 | H46 | 30.3° | 60.0° |
| C16 | C15 | C14 | H25 | 180.0° | 179.9° |
| C16 | C15 | C14 | H23 | 41.8° | 4.9° |
| C16 | C15 | C14 | H24 | 161.7° | 115.1° |
| C15 | C16 | C17 | H29 | 36.0° | 115.0° |
| C15 | C16 | C17 | H30 | 156.0° | 5.0° |
| C18 | C19 | C20 | H33 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 165.2° | 125.0° |
| C19 | C18 | C17 | H29 | 51.8° | 5.0° |
| C19 | C18 | C17 | H30 | 68.1° | 115.0° |
| C18 | C19 | C20 | H35 | 74.6° | 115.0° |
| C18 | C19 | C20 | H36 | 45.1° | 5.0° |
| C19 | C20 | C21 | H35 | 120.1° | 120.0° |
| C19 | C20 | C21 | H36 | 120.1° | 120.0° |
| C20 | C19 | C18 | H31 | 21.8° | 0.0° |
| C19 | C20 | H35 | H36 | 119.6° | 120.0° |
| C19 | C20 | C21 | H37 | 142.2° | 52.4° |
| C15 | C14 | C13 | H21 | 104.1° | 59.9° |
| C15 | C14 | C13 | H22 | 15.8° | 60.0° |
| C15 | C14 | H23 | H24 | 119.9° | 119.9° |
| C14 | C15 | C16 | H27 | 2.4° | 0.0° |
| C21 | C20 | C19 | H33 | 14.8° | 55.0° |
| C21 | C20 | H35 | H36 | 119.6° | 120.0° |
| C20 | C21 | C22 | H39 | 115.3° | 172.5° |
| O19 | C11 | C31 | C32 | 90.5° | 0.0° |
| O19 | C11 | C31 | H45 | 29.5° | 120.1° |
| O19 | C11 | C31 | H46 | 149.5° | 120.0° |
| C11 | C31 | C32 | H45 | 120.0° | 120.0° |
| C11 | C31 | C32 | H46 | 120.0° | 120.0° |
| C11 | C31 | C32 | C33 | 163.3° | 180.0° |
| C11 | C31 | H45 | H46 | 120.0° | 120.0° |
| C11 | C31 | C32 | H47 | 76.7° | 60.0° |
| C11 | C31 | C32 | H48 | 43.2° | 59.9° |
| C31 | C32 | C33 | H47 | 120.0° | 120.0° |
| C31 | C32 | C33 | H48 | 120.0° | 120.0° |
| C31 | C32 | C33 | C34 | 149.4° | 180.0° |
| C32 | C31 | H45 | H46 | 120.0° | 120.0° |
| C31 | C32 | H47 | H48 | 119.9° | 119.9° |
| C31 | C32 | C33 | H49 | 90.6° | 60.1° |
| C31 | C32 | C33 | H50 | 29.5° | 60.0° |
| C32 | C33 | C34 | H49 | 120.0° | 119.9° |
| C32 | C33 | C34 | H50 | 120.0° | 120.0° |
| C32 | C33 | C34 | C35 | 177.4° | 180.0° |
| C33 | C32 | C31 | H45 | 43.3° | 60.0° |
| C33 | C32 | C31 | H46 | 76.8° | 60.0° |
| C33 | C32 | H47 | H48 | 119.9° | 120.1° |
| C32 | C33 | H49 | H50 | 120.1° | 120.0° |
| C32 | C33 | C34 | H51 | 62.5° | 60.1° |
| C32 | C33 | C34 | H52 | 57.3° | 60.0° |
| C33 | C34 | C35 | H51 | 120.1° | 119.9° |
| C33 | C34 | C35 | H52 | 120.1° | 120.0° |
| C33 | C34 | C35 | C36 | 84.8° | 180.0° |
| C34 | C33 | C32 | H47 | 29.4° | 60.0° |
| C34 | C33 | C32 | H48 | 90.5° | 59.9° |
| C34 | C33 | H49 | H50 | 120.1° | 120.0° |
| C33 | C34 | H51 | H52 | 119.8° | 120.0° |
| C33 | C34 | C35 | H53 | 35.2° | 60.0° |
| C33 | C34 | C35 | H54 | 155.1° | 60.0° |
| C34 | C35 | C36 | H53 | 120.1° | 120.0° |
| C34 | C35 | C36 | H54 | 120.0° | 120.0° |
| C34 | C35 | C36 | C37 | 166.8° | 180.0° |
| C35 | C34 | C33 | H49 | 57.4° | 60.0° |
| C35 | C34 | C33 | H50 | 62.6° | 60.0° |
| C35 | C34 | H51 | H52 | 119.8° | 120.0° |
| C34 | C35 | H53 | H54 | 119.9° | 120.0° |
| C34 | C35 | C36 | H55 | 73.1° | 60.0° |
| C34 | C35 | C36 | H56 | 46.8° | 60.0° |
| C35 | C36 | C37 | H55 | 120.0° | 120.0° |
| C35 | C36 | C37 | H56 | 120.0° | 120.0° |
| C35 | C36 | C37 | C38 | 71.5° | 180.0° |
| C36 | C35 | C34 | H51 | 155.1° | 60.0° |
| C36 | C35 | C34 | H52 | 35.2° | 60.0° |
| C36 | C35 | H53 | H54 | 119.9° | 120.0° |
| C35 | C36 | H55 | H56 | 119.9° | 119.9° |
| C35 | C36 | C37 | H57 | 168.4° | 59.9° |
| C35 | C36 | C37 | H58 | 48.5° | 60.0° |
| C36 | C37 | C38 | H57 | 120.1° | 120.0° |
| C36 | C37 | C38 | H58 | 120.1° | 120.0° |
| C36 | C37 | C38 | C39 | 123.3° | 180.0° |
| C37 | C36 | C35 | H53 | 46.8° | 60.0° |
| C37 | C36 | C35 | H54 | 73.1° | 60.0° |
| C37 | C36 | H55 | H56 | 119.9° | 120.1° |
| C36 | C37 | H57 | H58 | 119.8° | 120.0° |
| C36 | C37 | C38 | H59 | 116.7° | 60.0° |
| C36 | C37 | C38 | H60 | 3.3° | 60.0° |
| C37 | C38 | C39 | H59 | 120.0° | 120.1° |
| C37 | C38 | C39 | H60 | 120.0° | 120.0° |
| C37 | C38 | C39 | C40 | 172.2° | 180.0° |
| C38 | C37 | C36 | H55 | 48.5° | 60.0° |
| C38 | C37 | C36 | H56 | 168.4° | 60.0° |
| C38 | C37 | H57 | H58 | 119.8° | 120.0° |
| C37 | C38 | H59 | H60 | 120.0° | 120.0° |
| C37 | C38 | C39 | H61 | 52.2° | 60.0° |
| C37 | C38 | C39 | H62 | 67.8° | 60.0° |
| C38 | C39 | C40 | H61 | 120.0° | 120.0° |
| C38 | C39 | C40 | H62 | 120.0° | 120.0° |
| C38 | C39 | C40 | C41 | 110.0° | 180.0° |
| C39 | C38 | C37 | H57 | 3.2° | 60.0° |
| C39 | C38 | C37 | H58 | 116.7° | 60.0° |
| C39 | C38 | H59 | H60 | 120.0° | 120.0° |
| C38 | C39 | H61 | H62 | 119.9° | 120.0° |
| C38 | C39 | C40 | H63 | 10.1° | 60.0° |
| C38 | C39 | C40 | H64 | 130.0° | 60.0° |
| C39 | C40 | C41 | H63 | 120.1° | 120.0° |
| C39 | C40 | C41 | H64 | 120.1° | 120.0° |
| C39 | C40 | C41 | C42 | 66.2° | 180.0° |
| C40 | C39 | C38 | H59 | 67.8° | 59.9° |
| C40 | C39 | C38 | H60 | 52.2° | 60.0° |
| C40 | C39 | H61 | H62 | 119.9° | 120.0° |
| C39 | C40 | H63 | H64 | 119.8° | 120.0° |
| C39 | C40 | C41 | H70 | 173.7° | 60.0° |
| C39 | C40 | C41 | H71 | 53.9° | 60.0° |
| C40 | C41 | C42 | H70 | 120.1° | 120.0° |
| C40 | C41 | C42 | H71 | 120.1° | 120.0° |
| C40 | C41 | C42 | C43 | 158.5° | 180.0° |
| C41 | C40 | C39 | H61 | 130.0° | 60.0° |
| C41 | C40 | C39 | H62 | 10.1° | 60.0° |
| C41 | C40 | H63 | H64 | 119.8° | 120.0° |
| C40 | C41 | H70 | H71 | 119.8° | 120.0° |
| C40 | C41 | C42 | H72 | 81.5° | 60.0° |
| C40 | C41 | C42 | H73 | 38.5° | 60.0° |
| C41 | C42 | C43 | H72 | 120.0° | 120.0° |
| C41 | C42 | C43 | H73 | 120.0° | 120.0° |
| C42 | C41 | C40 | H63 | 53.9° | 60.0° |
| C42 | C41 | C40 | H64 | 173.8° | 60.0° |
| C42 | C41 | H70 | H71 | 119.8° | 120.1° |
| C41 | C42 | H72 | H73 | 120.1° | 120.1° |
| C41 | C42 | C43 | H74 | 180.0° | 60.0° |
| C41 | C42 | C43 | H75 | 60.0° | 180.0° |
| C41 | C42 | C43 | H76 | 60.0° | 60.0° |
| C43 | C42 | C41 | H70 | 38.4° | 60.0° |
| C43 | C42 | C41 | H71 | 81.4° | 60.0° |
| C43 | C42 | H72 | H73 | 120.1° | 120.0° |
| C42 | C43 | H74 | H75 | 120.0° | 120.0° |
| C42 | C43 | H74 | H76 | 120.0° | 120.0° |
| C42 | C43 | H75 | H76 | 120.0° | 120.0° |
| H2 | O6 | C6 | H4 | 60.7° | 59.9° |
| H3 | C1 | C6 | H4 | 169.6° | 180.0° |
| H3 | C1 | C2 | H5 | 50.7° | 60.0° |
| H4 | C6 | C5 | H12 | 176.8° | 180.0° |
| H5 | C2 | O2 | H6 | 60.7° | 59.9° |
| H5 | C2 | C3 | H7 | 59.9° | 60.0° |
| H7 | C3 | O3 | H8 | 59.8° | 60.0° |
| H7 | C3 | C4 | H9 | 172.4° | 180.0° |
| H9 | C4 | C5 | H12 | 174.6° | 180.0° |
| H12 | C5 | O5 | H13 | 60.1° | 60.1° |
| H14 | C7 | C8 | H16 | 48.4° | 65.0° |
| H15 | C7 | C8 | H16 | 71.6° | 55.0° |
| H16 | C8 | C9 | H17 | 9.2° | 64.9° |
| H16 | C8 | C9 | H18 | 110.6° | 55.1° |
| H19 | C12 | C13 | H21 | 178.0° | 180.0° |
| H19 | C12 | C13 | H22 | 58.2° | 60.0° |
| H20 | C12 | C13 | H21 | 61.7° | 60.0° |
| H20 | C12 | C13 | H22 | 178.4° | 180.0° |
| H21 | C13 | C14 | H23 | 135.9° | 180.0° |
| H21 | C13 | C14 | H24 | 15.9° | 60.0° |
| H22 | C13 | C14 | H23 | 104.2° | 60.1° |
| H22 | C13 | C14 | H24 | 135.8° | 179.9° |
| H23 | C14 | C15 | H25 | 138.2° | 175.0° |
| H24 | C14 | C15 | H25 | 18.3° | 65.0° |
| H25 | C15 | C16 | H27 | 177.6° | 179.9° |
| H27 | C16 | C17 | H29 | 144.0° | 65.0° |
| H27 | C16 | C17 | H30 | 24.1° | 175.0° |
| H29 | C17 | C18 | H31 | 128.1° | 175.0° |
| H30 | C17 | C18 | H31 | 111.9° | 65.0° |
| H31 | C18 | C19 | H33 | 158.2° | 180.0° |
| H33 | C19 | C20 | H35 | 105.3° | 65.0° |
| H33 | C19 | C20 | H36 | 134.9° | 175.0° |
| H35 | C20 | C21 | H37 | 97.7° | 172.4° |
| H36 | C20 | C21 | H37 | 22.1° | 67.6° |
| H37 | C21 | C22 | H39 | 64.7° | 7.5° |
| H39 | C22 | C23 | H41 | 152.6° | 66.3° |
| H39 | C22 | C23 | H42 | 32.6° | 173.6° |
| H41 | C23 | C24 | H43 | 42.2° | 175.0° |
| H42 | C23 | C24 | H43 | 162.1° | 64.9° |
| H43 | C24 | C25 | H65 | 61.5° | 0.0° |
| H45 | C31 | C32 | H47 | 163.3° | 180.0° |
| H45 | C31 | C32 | H48 | 76.7° | 60.1° |
| H46 | C31 | C32 | H47 | 43.3° | 60.0° |
| H46 | C31 | C32 | H48 | 163.2° | 179.9° |
| H47 | C32 | C33 | H49 | 149.4° | 179.9° |
| H47 | C32 | C33 | H50 | 90.5° | 60.0° |
| H48 | C32 | C33 | H49 | 29.5° | 60.0° |
| H48 | C32 | C33 | H50 | 149.5° | 179.9° |
| H49 | C33 | C34 | H51 | 177.5° | 180.0° |
| H49 | C33 | C34 | H52 | 62.6° | 59.9° |
| H50 | C33 | C34 | H51 | 57.5° | 59.9° |
| H50 | C33 | C34 | H52 | 177.3° | NaN° |
| H51 | C34 | C35 | H53 | 84.9° | 179.9° |
| H51 | C34 | C35 | H54 | 35.1° | 59.9° |
| H52 | C34 | C35 | H53 | 155.3° | 60.0° |
| H52 | C34 | C35 | H54 | 84.8° | 180.0° |
| H53 | C35 | C36 | H55 | 166.8° | 180.0° |
| H53 | C35 | C36 | H56 | 73.3° | 60.0° |
| H54 | C35 | C36 | H55 | 46.9° | 60.0° |
| H54 | C35 | C36 | H56 | 166.8° | 180.0° |
| H55 | C36 | C37 | H57 | 71.6° | 179.9° |
| H55 | C36 | C37 | H58 | 168.6° | 59.9° |
| H56 | C36 | C37 | H57 | 48.3° | 60.0° |
| H56 | C36 | C37 | H58 | 71.5° | 180.0° |
| H57 | C37 | C38 | H59 | 123.2° | 180.0° |
| H57 | C37 | C38 | H60 | 116.8° | 60.0° |
| H58 | C37 | C38 | H59 | 3.4° | 60.0° |
| H58 | C37 | C38 | H60 | 123.3° | 180.0° |
| H59 | C38 | C39 | H61 | 172.2° | 179.9° |
| H59 | C38 | C39 | H62 | 52.3° | 60.0° |
| H60 | C38 | C39 | H61 | 67.9° | 60.0° |
| H60 | C38 | C39 | H62 | 172.2° | 179.9° |
| H61 | C39 | C40 | H63 | 109.9° | 180.0° |
| H61 | C39 | C40 | H64 | 9.9° | 60.0° |
| H62 | C39 | C40 | H63 | 130.1° | 60.0° |
| H62 | C39 | C40 | H64 | 110.0° | 180.0° |
| H63 | C40 | C41 | H70 | 66.2° | 180.0° |
| H63 | C40 | C41 | H71 | 174.0° | 60.0° |
| H64 | C40 | C41 | H70 | 53.7° | 60.0° |
| H64 | C40 | C41 | H71 | 66.2° | 180.0° |
| H65 | C25 | C26 | H67 | 0.0° | 0.0° |
| H65 | C25 | C26 | H68 | 120.0° | 120.0° |
| H65 | C25 | C26 | H69 | 120.0° | 119.9° |
| H67 | C26 | H68 | H69 | 120.0° | 120.0° |
| H70 | C41 | C42 | H72 | 158.4° | 180.0° |
| H70 | C41 | C42 | H73 | 81.6° | 59.9° |
| H71 | C41 | C42 | H72 | 38.6° | 59.9° |
| H71 | C41 | C42 | H73 | 158.6° | 180.0° |
| H72 | C42 | C43 | H74 | 60.0° | 60.0° |
| H72 | C42 | C43 | H75 | 180.0° | 60.0° |
| H72 | C42 | C43 | H76 | 60.0° | 180.0° |
| H73 | C42 | C43 | H74 | 60.0° | 180.0° |
| H73 | C42 | C43 | H75 | 60.0° | 60.0° |
| H73 | C42 | C43 | H76 | 180.0° | 60.0° |
| H74 | C43 | H75 | H76 | 120.0° | 120.0° |
